diethyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]quinoline-3,6-dicarboxylate

Systemtic Name: diethyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylate CAS Name: 4-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylate Traditional Name: 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylic acid diethyl ester Formula: C27H27N5O6S MolecularWeight: 549.59818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C27H27N5O6S/c1-5-37-25(33)18-7-12-23-21(14-18)24(22(15-28-23)26(34)38-6-2)31-19-8-10-20(11-9-19)39(35,36)32-27-29-16(3)13-17(4)30-27/h7-15H,5-6H2,1-4H3,(H,28,31)(H,29,30,32)